| SpectraBase Spectrum ID |
6PyVNdtCAo |
| Name |
4'-Methyl-2-(4'-methylbiphenyl-4-ylsulfonyl)biphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.134051120 u |
| Formula |
C26H22O2S |
| InChI |
InChI=1S/C26H22O2S/c1-19-7-11-21(12-8-19)22-15-17-24(18-16-22)29(27,28)26-6-4-3-5-25(26)23-13-9-20(2)10-14-23/h3-18H,1-2H3 |
| InChIKey |
FAUURACJNQBFHQ-UHFFFAOYSA-N |
| Molecular Weight |
398.520 g/mol |
| SMILES |
C=1(C(=CC=CC1)S(=O)(=O)C=1C=CC(=CC1)C=1C=CC(=CC1)C)C=1C=CC(=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898587 |
